SCHEMBL3988865

SCHEMBL3988865

CC(N)CC(=O)N1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
PKM P14618 2/20 0.46
TSHR P16473 3/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
FKBP1A P62942 2/20 0.45
POLB P06746 4/20 0.45
LMNA P02545 2/20 0.45
GLA P06280 1/20 0.45
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.43
HTT P42858 1/20 0.43
KDM4E B2RXH2 1/20 0.42
RAB9A P51151 1/20 0.42
GAA P10253 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL294992 0.84 POLB (0.55) L3MBTL1MEN1KMT2ASMN1; SMN2PKM
SCHEMBL8484573 0.82 L3MBTL1 (0.52) L3MBTL1MEN1KMT2ASMN1; SMN2PKM
SCHEMBL8484571 0.82 L3MBTL1 (0.52) L3MBTL1MEN1KMT2ASMN1; SMN2PKM
SCHEMBL14738409 0.82 ATM (0.46) L3MBTL1MEN1KMT2ASMN1; SMN2POLB
SCHEMBL10265713 0.82 ATM (0.46) L3MBTL1MEN1KMT2ASMN1; SMN2POLB
SCHEMBL9111586 0.81 L3MBTL1 (0.50) L3MBTL1MEN1KMT2ASMN1; SMN2PKM
SCHEMBL19261358 0.81 MEN1 (0.50) L3MBTL1MEN1KMT2ASMN1; SMN2PKM
SCHEMBL22651305 0.81 L3MBTL1 (0.50) L3MBTL1MEN1KMT2ASMN1; SMN2PKM
SCHEMBL8236391 0.80 L3MBTL1 (0.46) L3MBTL1MEN1KMT2ASMN1; SMN2PKM
Hydrochloric Acid SCHEMBL15124306 0.80 ATM (0.45) L3MBTL1MEN1KMT2ASMN1; SMN2POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1971333-A4 AMINO ACID DERIVATIVES OF INDOLINONE BASED PROTEIN KINASE INHIBITORS SCRIPPS RESEARCH INST (US) 2009-05-20 EP disclosed
US-20090068718-A1 AMINO ACID DERIVATIVES OF INDOLINONE BASED PROTEIN KINASE INHIBITORS LIANG CONGXIN 2009-03-12 US disclosed
US-20080269212-A1 Amino acid derivatives of indolinone based protein kinase inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2008-10-30 US disclosed
EP-1971333-A2 AMINO ACID DERIVATIVES OF INDOLINONE BASED PROTEIN KINASE INHIBITORS The Scripps Research Institute (US) 2008-09-24 EP disclosed
WO-2007081560-A2 AMINO ACID DERIVATIVES OF INDOLINONE BASED PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2007-07-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269212-A1 Amino acid derivatives of indolinone based protein kinase inhibitors PHKG1, MAP3K20, MKNK1 L3MBTL1 2000/4885MEN1 3952/4885KMT2A 1339/4885
US-20090068718-A1 AMINO ACID DERIVATIVES OF INDOLINONE BASED PROTEIN KINASE INHIBITORS PHKG1, MAP3K20, MKNK1 L3MBTL1 2000/4885MEN1 3952/4885KMT2A 1339/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.